MMs02328545 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2963 0.7548 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2908 2.2548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0165 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3183 5.2452 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6146 4.4904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6091 2.9904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3073 2.2452 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9053 2.2357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2071 2.9809 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2126 4.4809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5034 2.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8052 2.9714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1015 2.2166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0960 0.7166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 -0.0286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4979 0.7262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3922 -0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6940 0.7071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3867 -1.5381 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6830 -2.2929 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.6438 -2.8929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9848 -1.5477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2811 -2.3024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5828 -1.5572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5884 -0.0572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6775 -3.7929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9738 -4.5476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2798 5.2547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5815 4.5095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5871 3.0095 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8778 5.2643 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6038 1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -0.6038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6038 -1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0019 -1.0319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6395 -0.5866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1942 1.0510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 5.0866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1306 1.3193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6733 1.3136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0126 4.4853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2170 5.6809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4126 4.4765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8096 4.1714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1429 2.8128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7898 -1.2286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4565 0.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3453 -2.1343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2168 -0.6256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7595 -0.6312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5064 -3.2188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0490 -3.2245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9192 4.6681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8734 6.4643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8791 -2.3119 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -10.3757 -4.5381 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 33 2 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 29 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 2 0 0 0 0 27 58 1 0 0 0 0 29 30 2 0 0 0 0 29 59 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 34 56 1 0 0 0 0 34 57 1 0 0 0 0 M CHG 1 58 -1 M CHG 1 59 -1 M END